7L4J
Crystal structure of WT PPM1H phosphatase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS-II BEAMLINE 17-ID-2 |
Synchrotron site | NSLS-II |
Beamline | 17-ID-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-11-26 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.979354 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 70.688, 101.105, 148.974 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.966 - 2.451 |
R-factor | 0.1927 |
Rwork | 0.190 |
R-free | 0.24000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6b67 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.970 | 2.540 |
High resolution limit [Å] | 2.450 | 2.450 |
Rmerge | 0.080 | 0.781 |
Rmeas | 0.086 | 0.855 |
Rpim | 0.033 | 0.321 |
Number of reflections | 74295 | 3324 |
<I/σ(I)> | 14.6 | |
Completeness [%] | 99.1 | |
Redundancy | 6.7 | |
CC(1/2) | 0.998 | 0.779 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 288 | 0.1M imidazole 20% jeffamine ED-2001 |